N-[[(2S)-butan-2-yl]carbamoyl]-2-(2,3-dimethylpyridin-1-ium-1-yl)ethanamide

Systemtic Name: N-[[(2S)-butan-2-yl]carbamoyl]-2-(2,3-dimethylpyridin-1-ium-1-yl)ethanamide Openeye Name: 2-(2,3-dimethylpyridin-1-ium-1-yl)-N-[[(1S)-1-methylpropyl]carbamoyl]acetamide CAS Name: N-[[[(2S)-butan-2-yl]amino]-oxomethyl]-2-(2,3-dimethyl-1-pyridin-1-iumyl)acetamide IUPAC Name: N-[[(2S)-butan-2-yl]carbamoyl]-2-(2,3-dimethylpyridin-1-ium-1-yl)acetamide Traditional Name: 2-(2,3-dimethylpyridin-1-ium-1-yl)-N-[[(1S)-1-methylpropyl]carbamoyl]acetamide Formula: C14H22N3O2+ MolecularWeight: 264.34338

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC(=O)C[N+]1=CC=CC(=C1C)C

Isomeric SMILES

CC[C@H](C)NC(=O)NC(=O)C[N+]1=CC=CC(=C1C)C

InChI

InChI=1S/C14H21N3O2/c1-5-11(3)15-14(19)16-13(18)9-17-8-6-7-10(2)12(17)4/h6-8,11H,5,9H2,1-4H3,(H-,15,16,18,19)/p+1/t11-/m0/s1